N-(3-chloranyl-4-fluoranyl-phenyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Formula: C22H18ClFN2O5S MolecularWeight: 476.905123

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)F)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)F)Cl)OC1

InChI

InChI=1S/C22H18ClFN2O5S/c23-18-12-16(6-8-19(18)24)25-22(27)14-2-4-15(5-3-14)26-32(28,29)17-7-9-20-21(13-17)31-11-1-10-30-20/h2-9,12-13,26H,1,10-11H2,(H,25,27)